CHEMBL1615596
SMILES | Cn1c(=O)[nH]c2c([nH]c(=O)n2C)c1=N |
InChIKey | GLWLPSFWYSQAIN-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 3 |
Rotatable bonds | 0 |
Molecular weight (Da) | 195.1 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
5-HT1E | 5HT1E | Human | 5-Hydroxytryptamine | A | pKi | 5.54 | 5.54 | 5.54 | ChEMBL |
α1B | ADA1B | Human | Adrenoceptors | A | pKi | 6.12 | 6.12 | 6.12 | ChEMBL |
α1D | ADA1D | Human | Adrenoceptors | A | pKi | 6.3 | 6.3 | 6.3 | ChEMBL |
α1A | ADA1A | Human | Adrenoceptors | A | pKi | 6.05 | 6.05 | 6.05 | ChEMBL |
κ | OPRK | Human | Opioid | A | pKi | 5.75 | 5.75 | 5.75 | ChEMBL |
μ | OPRM | Human | Opioid | A | pKi | 5.05 | 5.05 | 5.05 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |